SCHEMBL16144454

SCHEMBL16144454

Fc1ccccc1N(c1ccccc1)c1ccc2ccc3c(N(c4ccccc4)c4nccc5ccccc45)ccc4ccc1c2c43

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
APEX1 P27695 1/20 0.31
MAPK1 P28482 1/20 0.31
PMP22 Q01453 1/20 0.31
CYP2A6 P11509 1/20 0.31
F12 P00748 1/20 0.31
PLAU P00749 1/20 0.31
NCF1 P14598 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
BACE1 P56817 1/20 0.31
TRPA1 O75762 1/20 0.30
CNR2 P34972 1/20 0.30
HPRT1 P00492 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16144429 0.94
SCHEMBL13320976 0.90 PLAU (0.37) LMNACYP3A4MAPTAPEX1MAPK1
SCHEMBL13320991 0.90 PLAU (0.37) LMNACYP3A4MAPTAPEX1MAPK1
SCHEMBL16144422 0.89 PLAU (0.36) LMNACYP3A4MAPTAPEX1MAPK1
SCHEMBL16144474 0.87
SCHEMBL13320969 0.84 MAPT (0.33) LMNACYP3A4MAPTAPEX1MAPK1
SCHEMBL15137929 0.83 ALDH1A1 (0.31) HPRT1
SCHEMBL16144475 0.83 EGFR (0.44) LMNAMAPT
SCHEMBL16144382 0.83 ALDH1A1 (0.31)
SCHEMBL16144403 0.82

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9583718-B2 Pyrene-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-9583718-B2 Pyrene-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-20140291646-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-10-02 US disclosed
US-20140291646-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-10-02 US disclosed